methyl 4-(4-methylphenyl)sulfanyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)sulfanyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 4-(p-tolylsulfanyl)benzothiophene-2-carboxylate CAS Name: 4-[(4-methylphenyl)thio]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)sulfanyl-1-benzothiophene-2-carboxylate Traditional Name: 4-(p-tolylthio)benzothiophene-2-carboxylic acid methyl ester Formula: C17H14O2S2 MolecularWeight: 314.42186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=CC3=C2C=C(S3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=CC3=C2C=C(S3)C(=O)OC

InChI

InChI=1S/C17H14O2S2/c1-11-6-8-12(9-7-11)20-14-4-3-5-15-13(14)10-16(21-15)17(18)19-2/h3-10H,1-2H3